SCHEMBL20338142

SCHEMBL20338142

CC1C(N=C=O)CCC[C@H]1N=C=O

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL43689 1.00 ALDH1A1 (0.44) ALDH1A1
SCHEMBL24699834 0.95 ALDH1A1 (0.50) ALDH1A1
SCHEMBL330951 0.88 ALDH1A1 (0.39) ALDH1A1
SCHEMBL26610 0.86 ALDH1A1 (0.50) ALDH1A1
SCHEMBL1136251 0.81 ALDH1A1 (0.39) ALDH1A1
SCHEMBL9323923 0.80 ALDH1A1 (0.57) ALDH1A1
SCHEMBL26012 0.80 ALDH1A1 (0.57) ALDH1A1
SCHEMBL5460574 0.80 ALDH1A1 (0.57) ALDH1A1
SCHEMBL11103013 0.80 ALDH1A1 (0.46) ALDH1A1
SCHEMBL1982615 0.80 ALDH1A1 (0.46) ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10308619-B2 Substituted triazines and a method for producing same COVESTRO DEUTSCHLAND AG (DE) 2019-06-04 US disclosed
US-20180186758-A1 SUBSTITUTED TRIAZINES AND A METHOD FOR PRODUCING SAME COVESTRO DEUTSCHLAND AG (DE) 2018-07-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180186758-A1 SUBSTITUTED TRIAZINES AND A METHOD FOR PRODUCING SAME CYP4Z1, TYR, DHPS ALDH1A1 440/4885
US-10308619-B2 Substituted triazines and a method for producing same CYP4Z1, TYR, DHPS ALDH1A1 440/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.